N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-chloro-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-chloro-N-(2-methoxyethyl)benzamide
N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-chloro-N-(2-methoxyethyl)benzamide
Compound characteristics
Compound ID: | V024-6464 |
Compound Name: | N-(2-{[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-4-chloro-N-(2-methoxyethyl)benzamide |
Molecular Weight: | 537.87 |
Molecular Formula: | C25 H27 Cl3 N4 O3 |
Smiles: | CC(C)(C)c1cc(NC(CN(CCOC)C(c2ccc(cc2)[Cl])=O)=O)n(c2ccc(c(c2)[Cl])[Cl])n1 |
Stereo: | ACHIRAL |
logP: | 6.0235 |
logD: | 6.0227 |
logSw: | -6.3032 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.355 |
InChI Key: | CEMRPZYRCYESCB-UHFFFAOYSA-N |